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SMILES: COc1ccc2sc(cc2c1)C(=O)NCc1ccc(NS(=O)(=O)C(F)(F)F)cc1

InChI Key: InChIKey=HAKUXQKDYZJDMN-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50229210   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50229210
PNG
(CHEMBL438346 | N-(4-(trifluoromethylsulfonamido)be...)
Show SMILES COc1ccc2sc(cc2c1)C(=O)NCc1ccc(NS(=O)(=O)C(F)(F)F)cc1
Show InChI InChI=1S/C18H15F3N2O4S2/c1-27-14-6-7-15-12(8-14)9-16(28-15)17(24)22-10-11-2-4-13(5-3-11)23-29(25,26)18(19,20)21/h2-9,23H,10H2,1H3,(H,22,24)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 80n/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha assessed as receptor activation by cell based assay


Bioorg Med Chem Lett 18: 710-5 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.053
BindingDB Entry DOI: 10.7270/Q2542NBN
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Mus musculus)
BDBM50229210
PNG
(CHEMBL438346 | N-(4-(trifluoromethylsulfonamido)be...)
Show SMILES COc1ccc2sc(cc2c1)C(=O)NCc1ccc(NS(=O)(=O)C(F)(F)F)cc1
Show InChI InChI=1S/C18H15F3N2O4S2/c1-27-14-6-7-15-12(8-14)9-16(28-15)17(24)22-10-11-2-4-13(5-3-11)23-29(25,26)18(19,20)21/h2-9,23H,10H2,1H3,(H,22,24)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 130n/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Agonist activity at mouse PPARalpha assessed as receptor activation by cell based assay


Bioorg Med Chem Lett 18: 710-5 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.053
BindingDB Entry DOI: 10.7270/Q2542NBN
More data for this
Ligand-Target Pair